SCHEMBL4760306

SCHEMBL4760306

CN(c1ccccc1)S(=O)(=O)c1cccs1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 1/20 0.61
ALDH1A1 P00352 5/20 0.53
HPGD P15428 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 2/20 0.51
MAPT P10636 4/20 0.51
HTT P42858 2/20 0.51
THRB P10828 1/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PKM P14618 1/20 0.47
GBA1 P04062 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7885963 0.79 ALDH1A1 (0.61) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL14507083 0.77 ALDH1A1 (0.51) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL7652738 0.76 ESR1 (0.55) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL4789668 0.75 ALDH1A1 (0.49) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL29268398 0.74 ALDH1A1 (0.56) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL12077803 0.73 ALDH1A1 (0.68) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL14507088 0.73 ALDH1A1 (0.41) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL812702 0.72 CA12 (0.78) NR1H3SMN1; SMN2LMNAMAPTHTT
SCHEMBL29150798 0.72 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2HSD17B10LMNAMAPT
SCHEMBL6122390 0.72 ALDH1A1 (0.61) NR1H3ALDH1A1HPGDSMN1; SMN2HSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1879877-B1 ANTIMICROBIAL AGENTS RANBAXY LAB LTD (IN) 2013-01-02 EP claimed
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP claimed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO claimed
EP-1879877-B1 ANTIMICROBIAL AGENTS RANBAXY LAB LTD (IN) 2013-01-02 EP disclosed
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP disclosed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed